N-[6-acetamido-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]benzamide

Systemtic Name: N-[6-acetamido-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]benzamide Openeye Name: N-(6-acetamido-2-benzylsulfanyl-4-oxo-1H-pyrimidin-5-yl)benzamide CAS Name: N-[6-acetamido-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]benzamide IUPAC Name: N-(6-acetamido-2-benzylsulfanyl-4-oxo-1H-pyrimidin-5-yl)benzamide Traditional Name: N-[6-acetamido-2-(benzylthio)-4-keto-1H-pyrimidin-5-yl]benzamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H18N4O3S/c1-13(25)21-17-16(22-18(26)15-10-6-3-7-11-15)19(27)24-20(23-17)28-12-14-8-4-2-5-9-14/h2-11H,12H2,1H3,(H,22,26)(H2,21,23,24,25,27)